Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKACA | P17612 | 3/20 | 0.65 |
| ▸ | PRKACG | P22612 | 2/20 | 0.65 |
| ▸ | PRKACB | P22694 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | ROCK2 | O75116 | 9/20 | 0.57 |
| ▸ | CIT | O14578 | 1/20 | 0.56 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.51 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | PRKX | P51817 | 1/20 | 0.46 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1647896 | 0.87 | PRKACA (0.65) | PRKACAPRKACGPRKACBSMN1; SMN2ROCK2 | |
| SCHEMBL12779509 | 0.85 | NUDT1 (0.49) | PRKACAPRKACGPRKACBSMN1; SMN2CIT | |
| SCHEMBL12779735 | 0.83 | ROCK2 (0.70) | PRKACAPRKACGPRKACBROCK2CIT | |
| SCHEMBL12779421 | 0.82 | PRKACA (0.77) | PRKACAPRKACGPRKACBSMN1; SMN2ROCK2 | |
| SCHEMBL1647780 | 0.79 | PRKACA (1.00) | PRKACAPRKACGPRKACBSMN1; SMN2ROCK2 | |
| SCHEMBL1647671 | 0.76 | ROCK2 (0.71) | PRKACAPRKACGPRKACBSMN1; SMN2ROCK2 | |
| SCHEMBL12779960 | 0.76 | CIT (0.49) | PRKACASMN1; SMN2ROCK2CITROCK1 | |
| SCHEMBL12779302 | 0.75 | ROCK2 (0.78) | PRKACAPRKACGPRKACBSMN1; SMN2ROCK2 | |
| SCHEMBL3244785 | 0.74 | CIT (0.57) | ROCK2CITROCK1TNIKDGAT2 | |
| SCHEMBL1647171 | 0.74 | PRKACA (0.61) | PRKACAPRKACGPRKACBSMN1; SMN2ROCK2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011050245-A1 | BICYCLIC HETEROARYLS AS KINASE INHIBITORS | FENG YANGBO (US) | 2011-04-28 | — | — | WO | disclosed |
| WO-2011050245-A1 | BICYCLIC HETEROARYLS AS KINASE INHIBITORS | FENG YANGBO (US) | 2011-04-28 | — | — | WO | disclosed |